8-[(4-amino-6-piperidin-1-yl-1,3,5-triazin-2-yl)methylsulfanyl]-7-ethyl-1,3-dimethylpurine-2,6-dione

SpectraBase Compound ID	H3ky3E9RrYm
InChI	InChI=1S/C18H25N9O2S/c1-4-27-12-13(24(2)18(29)25(3)14(12)28)22-17(27)30-10-11-20-15(19)23-16(21-11)26-8-6-5-7-9-26/h4-10H2,1-3H3,(H2,19,20,21,23)
InChIKey	SMKOFGXMPGXZIR-UHFFFAOYSA-N Google Search
Mol Weight	431.52 g/mol
Molecular Formula	C18H25N9O2S
Exact Mass	431.185192 g/mol

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SpectraBase Spectrum ID	1ow3eFK9P14
Name	8-[(4-amino-6-piperidin-1-yl-1,3,5-triazin-2-yl)methylsulfanyl]-7-ethyl-1,3-dimethylpurine-2,6-dione
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C18H25N9O2S
InChI	InChI=1S/C18H25N9O2S/c1-4-27-12-13(24(2)18(29)25(3)14(12)28)22-17(27)30-10-11-20-15(19)23-16(21-11)26-8-6-5-7-9-26/h4-10H2,1-3H3,(H2,19,20,21,23)
InChIKey	SMKOFGXMPGXZIR-UHFFFAOYSA-N
Molecular Weight	431.519 g/mol
SMILES	Nc1nc(nc(n1)CSc1nc2c(C(=O)N(C(N2C)=O)C)[n]1CC)N1CCCCC1
SPLASH	splash10-0006-7900000000-425633b7fd3d183c4a75
Synonyms	8-[(4-amino-6-piperidino-s-triazin-2-yl)methylthio]-7-ethyl-1,3-dimethyl-xanthine 8-[(4-azanyl-6-piperidin-1-yl-1,3,5-triazin-2-yl)methylsulfanyl]-7-ethyl-1,3-dimethyl-purine-2,6-dione 8-[[4-amino-6-(1-piperidinyl)-1,3,5-triazin-2-yl]methylthio]-7-ethyl-1,3-dimethylpurine-2,6-dione 8-[[4-amino-6-(1-piperidyl)-1,3,5-triazin-2-yl]methylsulfanyl]-7-ethyl-1,3-dimethyl-purine-2,6-dione
Wiley ID	1461408